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1,2,3,6-TETRA-O-ACETYL-4-O-(2',3'-DI-O-ACETYL-4'-O-BENZYL-6'-DEOXY-6'-FLUORO-ALPHA-D-GLUCOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID G4Aob00GEk4
InChI InChI=1S/C31H39FO16/c1-15(33)39-14-23-25(27(42-17(3)35)29(44-19(5)37)30(47-23)45-20(6)38)48-31-28(43-18(4)36)26(41-16(2)34)24(22(12-32)46-31)40-13-21-10-8-7-9-11-21/h7-11,22-31H,12-14H2,1-6H3/t22-,23-,24-,25-,26+,27+,28-,29-,30-,31-/m1/s1
InChIKey LALCZAGTACRPOF-GNZBLXBPSA-N
Mol Weight 686.6 g/mol
Molecular Formula C31H39FO16
Exact Mass 686.222213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HHFAoiTdsoh
Name 1,2,3,6-TETRA-O-ACETYL-4-O-(2',3'-DI-O-ACETYL-4'-O-BENZYL-6'-DEOXY-6'-FLUORO-ALPHA-D-GLUCOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H39FO16
InChI InChI=1S/C31H39FO16/c1-15(33)39-14-23-25(27(42-17(3)35)29(44-19(5)37)30(47-23)45-20(6)38)48-31-28(43-18(4)36)26(41-16(2)34)24(22(12-32)46-31)40-13-21-10-8-7-9-11-21/h7-11,22-31H,12-14H2,1-6H3/t22-,23-,24-,25-,26+,27+,28-,29-,30-,31-/m1/s1
InChIKey LALCZAGTACRPOF-GNZBLXBPSA-N
Literature Reference Author M.BRAITSCH,H.KAEHLIG,G.KONTAXIS,M.FISCHER,T.KAWADA,R.KONRAT, W.SCHMID
Literature Reference Citation BEIL.J.ORG.CHEM.,8,448(2012)
Literature Reference DOI 10.3762/bjoc.8.51
Molecular Weight 686.639 g/mol
Solvent CDCl3
Source File Reference UWIR10202